Mol:FL3FBDGS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
34 37 0 0 0 0 0 0 0 0999 V2000
2.2346 1.5656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2346 0.7406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9491 0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6635 0.7406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6635 1.5656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9491 1.9781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5201 0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8056 0.7406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0912 0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0912 -0.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8056 -0.9094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5201 -0.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6233 0.7406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3378 0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3378 -0.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6233 -0.9094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8056 -1.6276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0522 0.7406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6233 -1.5953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3691 1.9672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2380 0.4090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5381 0.9795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1256 0.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3275 0.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5343 0.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9467 0.9619 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7449 0.7529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9018 1.3385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3815 1.6155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0212 0.4965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5742 0.5240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4990 -0.1656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0212 0.8611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2865 -1.9781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
2 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 7 2 0 0 0 0
9 13 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 10 1 0 0 0 0
14 18 1 0 0 0 0
11 17 2 0 0 0 0
16 19 1 0 0 0 0
5 20 1 0 0 0 0
4 21 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 22 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
22 30 1 0 0 0 0
23 31 1 0 0 0 0
24 32 1 0 0 0 0
25 18 1 0 0 0 0
21 33 1 0 0 0 0
19 34 1 0 0 0 0
S SKP 8
ID FL3FBDGS0001
KNApSAcK_ID C00013683
NAME Luteolin 5,3'-dimethyl ether 7-glucoside;7-(beta-D-Glucopyranosyloxy)-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-4H-1-benzopyran-4-one
CAS_RN 172853-43-9
FORMULA C23H24O11
EXACTMASS 476.13186161
AVERAGEMASS 476.43006
SMILES O=C(c31)C=C(c(c4)cc(c(c4)O)OC)Oc1cc(cc(OC)3)OC(C2O)OC(CO)C(C2O)O
M END
